Structure Information
Structure

Compound Identification

SMILES

CC1=CC=C(CN(CC2=CC3=C(OCO3)C=C2)C(=O)CN(CC=C)C(=O)C2=CC(Cl)=C(Cl)C=C2)O1

InChIKey

InChIKey=IMLBCSRRXWKOHO-UHFFFAOYSA-N

Formula

C26H24Cl2N2O5

Mass

515.39

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Benzoic acids and derivatives

Intermediate Tree Nodes

Benzamides

Direct Parent

Hippuric acids and derivatives

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Hippuric acid or derivatives - Alpha-amino acid or derivatives - 3-halobenzoic acid or derivatives - 4-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Benzodioxole - 1,2-dichlorobenzene - Benzoyl - Chlorobenzene - Halobenzene - Aryl halide - Aryl chloride - Tertiary carboxylic acid amide - Furan - Heteroaromatic compound - Carboxamide group - Oxacycle - Organoheterocyclic compound - Carboxylic acid derivative - Acetal - Organic nitrogen compound - Organohalogen compound - Organochloride - Organonitrogen compound - Carbonyl group - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as hippuric acids and derivatives. These are compounds containing a hippuric acid or a derivative, with a structure characterized the presence of a benzoyl group linked to the N-terminal of a glycine.

External Descriptors

Not available

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